Sentence examples for subsequent docking from inspiring English sources

Glide (Schrödinger, LLC) was used to generate the receptor grid for subsequent docking and scoring the docked ligands in Standard Precision (SP) mode.

The restraint weight value w = 1.0 kcal/(mol Å2) was found to yield the best cross-docking results and so used in all subsequent docking simulations.

If the launch succeeds, and if the subsequent docking succeeds, Anderson will be the first private citizen to send two men into space.

By way of Oran, Oujda, and Casablanca, then overland to the north of Spain and with a subsequent docking in Havana, the family reached Ellis Island on March 12 , 1941

The minimum-energy structure was used for the subsequent docking calculations.

A popular adaptation is the pre-calculation of diverse ligand conformations for subsequent docking in target active sites.

Then, we have chosen the urokinase structure (1SQO protein from the PDB [ 66]) for subsequent calculations: docking by the SOL program, postprocessing by the DISCORE program, quantum chemistry calculations by the MOPAC package, and generalized docking by the FLM program.

Subsequent molecular docking experiments showed that all the compounds which inhibited PARN can efficiently bind into the active site of the enzyme through specific interactions.

Ten structures were produced, and the one with the best score was used for subsequent virtual docking.

However, due to the requirement for subsequent substrate docking into the active site, the E S interface is expected to overlap with that observed in the crystal structures.

The poses obtained subsequent to docking were scored using our scoring scheme DockScore in order to identify the optimal interactions between the putative interacting TFs.